5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate
TL;DR: 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate (CAS 457650-77-0) is a chemical compound with molecular formula C21H18ClFN2O3 and molecular weight 400.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-chloro-7-(morpholin-4-ylmethyl)quinolin-8-yl] 4-fluorobenzoate
Also Known As: CBKinase1_010458, CBKinase1_022858, 5-chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate, BRD-K28926523-001-01-5, [5-chloro-7-(morpholin-4-ylmethyl)quinolin-8-yl] 4-fluorobenzoate
| Molecular Formula | C21H18ClFN2O3 |
|---|---|
| Molecular Weight | 400.10 g/mol |
| LogP | 4.0787 |
| Topological Polar Surface Area | 51.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.099 |
| Heavy Atoms | 28 |
| Complexity | 1004.45337 |
Chemical Identifiers
| CAS Number | 457650-77-0 |
|---|---|
| SMILES | C1COCCN1CC2=CC(=C3C=CC=NC3=C2OC(=O)C4=CC=C(C=C4)F)Cl |
Product Overview
5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate (CAS 457650-77-0), with molecular formula C21H18ClFN2O3 and molecular weight 400.10 g/mol. IUPAC: [5-chloro-7-(morpholin-4-ylmethyl)quinolin-8-yl] 4-fluorobenzoate.
Chemical Property Profile of 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate
Property Insights of 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate
The XLogP value of 4.0787 indicates that 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.66 Ų, 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate?
The CAS number of 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate is 457650-77-0.
What is the molecular formula of 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate?
The molecular formula of 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate is C21H18ClFN2O3.
What is the molecular weight of 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate?
The molecular weight of 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate is 400.10 g/mol.
Where can I buy 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate?
You can request a quote for 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-7-(4-morpholinylmethyl)-8-quinolinyl 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.